Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine
TL;DR: Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine (CAS 70419-16-8) is a chemical compound with molecular formula C29H37N13O14P2 and molecular weight 853.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-[[1-[(2S,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]-2-[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-phosphonooxyoxolan-2-yl]ethoxy]methyl]oxolan-3-yl] dihydrogen phosphate
Also Known As: d(Apcpa), Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine, [(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-[[1-[(2S,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]-2-[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-phosphonooxyoxolan-2-yl]ethoxy]methyl]oxolan-3-yl] dihydrogen phosphate, Adenosine, 2'-deoxyadenylyl-(3'-5')-2'-deoxycytidylyl-(3'-5')-2'-deoxy-, [(2R,3S,5R)-2-[2-[[(2R,3S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-phosphonooxy-oxolan-2-yl]methoxy]-2-[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-oxolan-2-yl]ethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxyphosphonic acid
| Molecular Formula | C29H37N13O14P2 |
|---|---|
| Molecular Weight | 853.21 g/mol |
| LogP | -1.3758 |
| Topological Polar Surface Area | 390.82 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 13 |
| Exact Mass | 853.2058 |
| Heavy Atoms | 58 |
| Complexity | 2460.3975 |
Chemical Identifiers
| CAS Number | 70419-16-8 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N)C(C[C@@H]4[C@H](C[C@@H](O4)N5C=NC6=C(N=CN=C65)N)OP(=O)(O)O)OC[C@@H]7[C@H](C[C@@H](O7)N8C=CC(=NC8=O)N)OP(=O)(O)O)O |
Product Overview
Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine (CAS 70419-16-8), with molecular formula C29H37N13O14P2 and molecular weight 853.21 g/mol. IUPAC: [(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-[[1-[(2S,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]-2-[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-phosphonooxyoxolan-2-yl]ethoxy]methyl]oxolan-3-yl] dihydrogen phosphate.
Chemical Property Profile of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine
Property Insights of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine
The XLogP value of -1.3758 indicates that Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 390.82 Ų indicates high polarity, suggesting Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine has 8 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine?
The CAS number of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine is 70419-16-8.
What is the molecular formula of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine?
The molecular formula of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine is C29H37N13O14P2.
What is the molecular weight of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine?
The molecular weight of Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine is 853.21 g/mol.
Where can I buy Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine?
You can request a quote for Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine?
Yes, KEHONG BIO provides custom synthesis services for Deoxyadenylyl-(3'-5')-deoxycytidylyl-(3'-5')-deoxyadenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.